HEADER    PROTEIN                                 24-JUN-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-JUN-21         0                                  
HETATM    1  C   UNK     0      -3.962   0.753   0.455  0.00  0.00           C+0
HETATM    2  C   UNK     0      -2.579   0.671  -0.167  0.00  0.00           C+0
HETATM    3  O   UNK     0      -2.748   0.138  -1.464  0.00  0.00           O+0
HETATM    4  C   UNK     0      -1.717  -0.333   0.575  0.00  0.00           C+0
HETATM    5  O   UNK     0      -1.482   0.079   1.867  0.00  0.00           O+0
HETATM    6  C   UNK     0      -0.483  -0.579  -0.184  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.632   0.092  -0.107  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.929   1.227   0.730  0.00  0.00           C+0
HETATM    9  O   UNK     0       0.136   2.007   1.320  0.00  0.00           O+0
HETATM   10  O   UNK     0       2.331   1.387   0.825  0.00  0.00           O+0
HETATM   11  C   UNK     0       2.893   0.215   0.279  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.281   0.398  -0.242  0.00  0.00           C+0
HETATM   13  C   UNK     0       1.917  -0.129  -0.857  0.00  0.00           C+0
HETATM   14  O   UNK     0       2.048  -1.441  -1.245  0.00  0.00           O+0
HETATM   15  H   UNK     0      -3.954   1.213   1.446  0.00  0.00           H+0
HETATM   16  H   UNK     0      -4.365  -0.280   0.481  0.00  0.00           H+0
HETATM   17  H   UNK     0      -4.594   1.304  -0.283  0.00  0.00           H+0
HETATM   18  H   UNK     0      -2.090   1.645  -0.208  0.00  0.00           H+0
HETATM   19  H   UNK     0      -3.392  -0.602  -1.458  0.00  0.00           H+0
HETATM   20  H   UNK     0      -2.297  -1.293   0.604  0.00  0.00           H+0
HETATM   21  H   UNK     0      -1.546  -0.699   2.470  0.00  0.00           H+0
HETATM   22  H   UNK     0      -0.490  -1.427  -0.907  0.00  0.00           H+0
HETATM   23  H   UNK     0       2.859  -0.616   1.020  0.00  0.00           H+0
HETATM   24  H   UNK     0       4.975   0.416   0.606  0.00  0.00           H+0
HETATM   25  H   UNK     0       4.515  -0.498  -0.875  0.00  0.00           H+0
HETATM   26  H   UNK     0       4.355   1.318  -0.830  0.00  0.00           H+0
HETATM   27  H   UNK     0       2.029   0.601  -1.677  0.00  0.00           H+0
HETATM   28  H   UNK     0       1.798  -1.591  -2.175  0.00  0.00           H+0
CONECT    1    2   15   16   17                                             
CONECT    2    1    3    4   18                                             
CONECT    3    2   19                                                       
CONECT    4    2    5    6   20                                             
CONECT    5    4   21                                                       
CONECT    6    4    7   22                                                  
CONECT    7    6    8   13                                                  
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11                                                       
CONECT   11   10   12   13   23                                             
CONECT   12   11   24   25   26                                             
CONECT   13   11   14    7   27                                             
CONECT   14   13   28                                                       
CONECT   15    1                                                            
CONECT   16    1                                                            
CONECT   17    1                                                            
CONECT   18    2                                                            
CONECT   19    3                                                            
CONECT   20    4                                                            
CONECT   21    5                                                            
CONECT   22    6                                                            
CONECT   23   11                                                            
CONECT   24   12                                                            
CONECT   25   12                                                            
CONECT   26   12                                                            
CONECT   27   13                                                            
CONECT   28   14                                                            
MASTER        0    0    0    0    0    0    0    0   28    0   56    0
END